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【求助】审稿人的意见如何修改
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审稿人给我的意见里 Why did you use 29 refinement restraints in a structure with so few parameters? To which parameters were restraints applied? 我的cif是这样的 _refine_ls_structure_factor_coef Fsqd _refine_ls_matrix_type full _refine_ls_weighting_scheme calc _refine_ls_weighting_details 'calc w=1/[\s^2^(Fo^2^)+(0.069P)^2^+0.0P] where P=(Fo^2^+2Fc^2^)/3' _atom_sites_solution_primary direct _atom_sites_solution_secondary difmap _atom_sites_solution_hydrogens geom _refine_ls_hydrogen_treatment constr _refine_ls_extinction_method none _refine_ls_extinction_coef ? _refine_ls_number_reflns 1271 _refine_ls_number_parameters 64 _refine_ls_number_restraints 29 _refine_ls_R_factor_all 0.1178 _refine_ls_R_factor_gt 0.0572 _refine_ls_wR_factor_ref 0.1472 _refine_ls_wR_factor_gt 0.1224 _refine_ls_goodness_of_fit_ref 1.004 _refine_ls_restrained_S_all 1.022 _refine_ls_shift/su_max 0.000 _refine_ls_shift/su_mean 0.000 这个该如何解释啊 |
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2楼2010-10-27 23:56:30
3楼2010-10-28 08:56:28